SCHEMBL6400875

SCHEMBL6400875

COc1ccc(Nc2nnc(-c3ccc(F)c(F)c3Nc3ccc(I)cc3F)o2)c(OC)c1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DUSP3 P51452 1/20 0.45
MAP2K1 Q02750 9/20 0.41
MAP2K2 P36507 7/20 0.41
MAPT P10636 3/20 0.41
ALDH1A1 P00352 2/20 0.41
LMNA P02545 2/20 0.41
KDM4E B2RXH2 1/20 0.41
USP2 O75604 1/20 0.41
TP53 P04637 1/20 0.41
GLA P06280 1/20 0.41
HPGD P15428 1/20 0.41
ALOX15 P16050 1/20 0.41
HSD17B10 Q99714 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
FLT1 P17948 1/20 0.40
NPC1 O15118 1/20 0.39
CRHBP P24387 1/20 0.39
RAB9A P51151 1/20 0.39
CRHR2 Q13324 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL6206345 0.91 DUSP3 (0.39) DUSP3MAP2K1MAP2K2MAPTALDH1A1
SCHEMBL6400835 0.85 DUSP3 (0.37) DUSP3MAP2K1MAP2K2MAPTALDH1A1
SCHEMBL6207706 0.80 ALDH1A1 (0.38) DUSP3MAP2K1MAP2K2ALDH1A1KDM4E
SCHEMBL6406299 0.80 PIM1 (0.44) MAP2K1MAP2K2MAPTALDH1A1KDM4E
SCHEMBL6399775 0.79 MAP2K1 (0.46) MAP2K1MAP2K2ALDH1A1KDM4ETP53
SCHEMBL6208038 0.79 PIM1 (0.45) MAP2K1MAP2K2PIM1CAMK2B
SCHEMBL6406565 0.79 PIM1 (0.39) MAP2K1MAP2K2MAPTALDH1A1LMNA
SCHEMBL6399813 0.78 MAP2K1 (0.43) MAP2K1MAP2K2PIM1CAMK2B
SCHEMBL6406148 0.78 MAP2K1 (0.41) MAP2K1MAP2K2PIM1CAMK2B
SCHEMBL6187892 0.78 MAP2K1 (0.45) MAP2K1MAP2K2PIM1CAMK2B

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050004186-A1 MEK inhibiting compounds PFIZER INC 2005-01-06 US claimed
US-20050004186-A1 MEK inhibiting compounds PFIZER INC 2005-01-06 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20050004186-A1 MEK inhibiting compounds MAPK1, MAP3K1, MAPK3 DUSP3 80/4885MAP2K1 46/4885MAP2K2 40/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.